923911

Source:http://linkedlifedata.com/resource/chembl/compound/923911

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C21H22ClN3O4S2/c1-13-23-20(19-15-4-2-3-5-18(15)30-21(19)24-13)29-17-7-6-14(12-16(17)22)31(26,27)25-8-10-28-11-9-25/h6-7,12H,2-5,8-11H2,1H3
chemicalCompound:standardIn...	NKZKNHLZKAODPL-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1nc(Oc2ccc(cc2Cl)S(=O)(=O)N3CCOCC3)c4c5CCCCc5sc4n1
chemicalCompound:molecularF...	C21H22ClN3O4S2
chemicalCompound:moleculeId	923911
chemicalCompound:mwFreebase	480
chemicalCompound:alogp	4.019
chemicalCompound:hba	6
chemicalCompound:hbd	0
chemicalCompound:psa	118.24
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.407
chemicalCompound:acdLogD	4.407
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	480
chemicalCompound:acdMostBpk...	2.181
chemicalCompound:chemblId	CHEMBL1500027
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1023911
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:3627045, activity:3704599, activity:3863671, activity:3988887, activity:4148754, activity:4381861, activity:4696751, activity:4889996, activity:5494889, activity:5949193, activity:6515446, activity:6942408, activity:7191132, activity:7252110, activity:7339268, activity:7496838